UCSF

ZINC22064236

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 32 No

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Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.47 1.2 -54.46 7 10 0 177 443.456 3
Mid Mid (pH 6-8) -0.47 -0.85 -55.13 6 10 -1 176 442.448 3

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )